3-(4,5,6,7-tetrahydro-1-benzothiophen-2-ylcarbonylamino)benzoate

Systemtic Name: 3-(4,5,6,7-tetrahydro-1-benzothiophen-2-ylcarbonylamino)benzoate Openeye Name: 3-(4,5,6,7-tetrahydrobenzothiophene-2-carbonylamino)benzoate CAS Name: 3-[[oxo(4,5,6,7-tetrahydro-1-benzothiophen-2-yl)methyl]amino]benzoate IUPAC Name: 3-(4,5,6,7-tetrahydro-1-benzothiophene-2-carbonylamino)benzoate Traditional Name: 3-(4,5,6,7-tetrahydrobenzothiophene-2-carbonylamino)benzoate Formula: C16H14NO3S- MolecularWeight: 300.35226

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=C(S2)C(=O)NC3=CC=CC(=C3)C(=O)[O-]

Isomeric SMILES

C1CCC2=C(C1)C=C(S2)C(=O)NC3=CC=CC(=C3)C(=O)[O-]

InChI

InChI=1S/C16H15NO3S/c18-15(14-9-10-4-1-2-7-13(10)21-14)17-12-6-3-5-11(8-12)16(19)20/h3,5-6,8-9H,1-2,4,7H2,(H,17,18)(H,19,20)/p-1